REMARK  Name = BDB057273
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.264  -1.234   2.526  0.00  0.00    +0.139 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.777  -0.180   2.256  0.00  0.00    -0.030 A 
ATOM      3  C   LIG    1        1.746  -0.373   1.258  0.00  0.00    +0.015 A 
ATOM      4  C   LIG    1        2.704   0.611   0.969  0.00  0.00    +0.002 A 
ATOM      5  C   LIG    1        2.674   1.808   1.698  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        1.708   2.016   2.686  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        0.762   1.030   2.961  0.00  0.00    +0.005 A 
BRANCH   4   8
ATOM      8  C   LIG    1        3.687   0.361  -0.078  0.00  0.00    +0.089 A 
ATOM      9  N   LIG    1        3.655  -0.777  -0.883  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1        4.682  -0.639  -1.677  0.00  0.00    +0.110 A 
ATOM     11  C   LIG    1        5.314  -1.403  -2.768  0.00  0.00    +0.076 C 
ATOM     12  C   LIG    1        6.695  -0.706  -2.874  0.00  0.00    +0.029 C 
ATOM     13  C   LIG    1        6.510   0.700  -2.273  0.00  0.00    +0.123 C 
ATOM     14  N   LIG    1        5.354   0.514  -1.425  0.00  0.00    -0.334 N 
ATOM     15  C   LIG    1        4.762   1.175  -0.416  0.00  0.00    +0.115 A 
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  17
ATOM     16  C   LIG    1       -2.545  -0.342   2.283  0.00  0.00    +0.244 C 
ATOM     17  N   LIG    1       -1.453  -0.985   1.742  0.00  0.00    -0.307 N 
ATOM     18  H   LIG    1       -1.328  -0.965   0.740  0.00  0.00    +0.149 HD
ATOM     19  O   LIG    1       -2.640  -0.035   3.466  0.00  0.00    -0.270 OA
BRANCH  16  25
ATOM     20  C   LIG    1       -4.931  -0.397  -0.681  0.00  0.00    +0.124 A 
ATOM     21  C   LIG    1       -5.704   0.749  -0.409  0.00  0.00    -0.009 A 
ATOM     22  C   LIG    1       -6.818   1.161  -1.333  0.00  0.00    +0.047 C 
ATOM     23  C   LIG    1       -5.442   1.506   0.742  0.00  0.00    +0.007 A 
ATOM     24  C   LIG    1       -4.416   1.137   1.611  0.00  0.00    +0.013 A 
ATOM     25  C   LIG    1       -3.634   0.013   1.331  0.00  0.00    +0.040 A 
ATOM     26  C   LIG    1       -3.901  -0.761   0.193  0.00  0.00    +0.059 A 
BRANCH  20  28
ATOM     27  C   LIG    1       -4.545  -2.267  -2.116  0.00  0.00    +0.277 C 
ATOM     28  O   LIG    1       -5.271  -1.082  -1.818  0.00  0.00    -0.495 OA
ENDBRANCH  20  28
ENDBRANCH  16  25
ENDBRANCH   1  17
TORSDOF 5